1-phenethyl-3-[(1R,2R)-1-pyrrolidin-1-ium-1-yl-1-thiophen-2-yl-propan-2-yl]thiourea

Systemtic Name: 1-phenethyl-3-[(1R,2R)-1-pyrrolidin-1-ium-1-yl-1-thiophen-2-yl-propan-2-yl]thiourea Openeye Name: 1-[(1R,2R)-1-methyl-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]-3-phenethyl-thiourea CAS Name: 1-phenethyl-3-[(1R,2R)-1-(1-pyrrolidin-1-iumyl)-1-thiophen-2-ylpropan-2-yl]thiourea IUPAC Name: 1-phenethyl-3-[(1R,2R)-1-pyrrolidin-1-ium-1-yl-1-thiophen-2-ylpropan-2-yl]thiourea Traditional Name: 1-[(1R,2R)-1-methyl-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]-3-phenethyl-thiourea Formula: C20H28N3S2+ MolecularWeight: 374.58642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CS1)[NH+]2CCCC2)NC(=S)NCCC3=CC=CC=C3

Isomeric SMILES

C[C@H]([C@H](C1=CC=CS1)[NH+]2CCCC2)NC(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C20H27N3S2/c1-16(19(18-10-7-15-25-18)23-13-5-6-14-23)22-20(24)21-12-11-17-8-3-2-4-9-17/h2-4,7-10,15-16,19H,5-6,11-14H2,1H3,(H2,21,22,24)/p+1/t16-,19-/m1/s1